Isonicotinaldehyde Oxime
d8221409-242f-444a-8568-214e19f350a8
Identity
- Substance
- fo-dc5307e163727452 NeutralMolecule
- Source
- EF 3.1
- Unit
- kg
- Context
- Environmental → Air → Aircraft cruise height
- CAS
- 696-54-8
- EC
- 211-796-6
Context
- Dimension
- Environmental
- Media
- Air
- Strata
- Aircraft cruise height
Alternative labels
6- 4-(Hydroxyiminomethyl)pyridine
- 4-Pyridinaldoxime
- 4-Pyridinealdoxime
- 4-Pyridinecarboxaldehyde, oxime
- Isonicotinaldehyde, oxime
- Pyridine-4-carboxaldoxime
Source lists
1| List | Version | Source flow | Name there | Why this flow |
|---|---|---|---|---|
| EF | 3.1 | d8221409-242f-444a-8568-214e19f350a8 | isonicotinaldehyde oxime | The consensus list is built from this one, so this row is the flow itself rather than something matched to it. |
Concept associations
1| Source list | Source flow | Name there | Compartment there | Match | Conversion |
|---|---|---|---|---|---|
| EF 3.1 | d8221409-242f-444a-8568-214e19f350a8 | isonicotinaldehyde oxime | Emissions/Emissions to air/Emissions to lower stratosphere and upper troposphere | exactMatch | — |
History
The change log and the PROV-O trail (2 consensus changes)
These are the heaviest sections of this page and the least often read, so the page does not pay for them until you ask.
Full record
Flow JSON
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